4-[3-(cyclopropylmethylamino)-3-oxidanylidene-propyl]-5-thiophen-2-yl-1,2,4-triazole-3-thiolate

Systemtic Name: 4-[3-(cyclopropylmethylamino)-3-oxidanylidene-propyl]-5-thiophen-2-yl-1,2,4-triazole-3-thiolate Openeye Name: 4-[3-(cyclopropylmethylamino)-3-oxo-propyl]-5-(2-thienyl)-1,2,4-triazole-3-thiolate CAS Name: 4-[3-(cyclopropylmethylamino)-3-oxopropyl]-5-thiophen-2-yl-1,2,4-triazole-3-thiolate IUPAC Name: 4-[3-(cyclopropylmethylamino)-3-oxopropyl]-5-thiophen-2-yl-1,2,4-triazole-3-thiolate Traditional Name: 4-[3-(cyclopropylmethylamino)-3-keto-propyl]-5-(2-thienyl)-1,2,4-triazole-3-thiolate Formula: C13H15N4OS2- MolecularWeight: 307.4144

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1CNC(=O)CCN2C(=NN=C2[S-])C3=CC=CS3

Isomeric SMILES

C1CC1CNC(=O)CCN2C(=NN=C2[S-])C3=CC=CS3

InChI

InChI=1S/C13H16N4OS2/c18-11(14-8-9-3-4-9)5-6-17-12(15-16-13(17)19)10-2-1-7-20-10/h1-2,7,9H,3-6,8H2,(H,14,18)(H,16,19)/p-1